2-methylpropyl 2-chloro-5-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Chemical Structure Depiction of
2-methylpropyl 2-chloro-5-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
2-methylpropyl 2-chloro-5-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Compound characteristics
| Compound ID: | 5646-1393 |
| Compound Name: | 2-methylpropyl 2-chloro-5-(5-{[3-methyl-5-oxo-1-(4-sulfamoylphenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate |
| Molecular Weight: | 542.01 |
| Molecular Formula: | C26 H24 Cl N3 O6 S |
| Smiles: | CC(C)COC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(C)=NN(C2=O)c2ccc(cc2)S(N)(=O)=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9923 |
| logD: | 4.9913 |
| logSw: | -5.0235 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.889 |
| InChI Key: | FSGWNLBOKPAYQY-UHFFFAOYSA-N |